2-chloranyl-3,4,5-tris(oxidanyl)benzoate; 1-ethyl-3-methyl-2H-imidazole

Systemtic Name: 2-chloranyl-3,4,5-tris(oxidanyl)benzoate; 1-ethyl-3-methyl-2H-imidazole Openeye Name: 2-chloro-3,4,5-trihydroxy-benzoate; 1-ethyl-3-methyl-2H-imidazole CAS Name: 2-chloro-3,4,5-trihydroxybenzoate; 1-ethyl-3-methyl-2H-imidazole IUPAC Name: 2-chloro-3,4,5-trihydroxybenzoate; 1-ethyl-3-methyl-2H-imidazole Traditional Name: 2-chloro-3,4,5-trihydroxy-benzoate; 1-ethyl-3-methyl-4-imidazoline Formula: C13H16ClN2O5- MolecularWeight: 315.72954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CN(C=C1)C.C1=C(C(=C(C(=C1O)O)O)Cl)C(=O)[O-]

Isomeric SMILES

CCN1CN(C=C1)C.C1=C(C(=C(C(=C1O)O)O)Cl)C(=O)[O-]

InChI

InChI=1S/C7H5ClO5.C6H12N2/c8-4-2(7(12)13)1-3(9)5(10)6(4)11;1-3-8-5-4-7(2)6-8/h1,9-11H,(H,12,13);4-5H,3,6H2,1-2H3/p-1